Cannabidiolic acid

Base Information Edit

Chemical Name:Cannabidiolic acid
CAS No.:1244-58-2
Molecular Formula:C22H30 O4
Molecular Weight:358.478
Hs Code.:
European Community (EC) Number:423-050-9,857-126-1
UNII:FJX8O3OJCD
DSSTox Substance ID:DTXSID80154318
Nikkaji Number:J14.354E
Wikipedia:Cannabidiolic_acid
Wikidata:Q27106043
Metabolomics Workbench ID:27991
ChEMBL ID:CHEMBL498672
Mol file:1244-58-2.mol

Synonyms:cannabidiolic acid

This product is a nationally controlled contraband, and the Lookchem platform doesn't provide relevant sales information.

Chemical Property of Cannabidiolic acid Edit

Chemical Property:

Vapor Pressure:4.27E-12mmHg at 25°C
Melting Point:45-48 °C
Boiling Point:530.8°Cat760mmHg
PKA:3.41±0.43(Predicted)
Flash Point:288.9°C
PSA：77.76000
Density:1.123g/cm³
LogP:5.54470
Storage Temp.:−20°C
XLogP3:6.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:358.21440943
Heavy Atom Count:26
Complexity:538

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CCCCCC1=CC(=C(C(=C1C(=O)O)O)C2C=C(CCC2C(=C)C)C)O
Isomeric SMILES:CCCCCC1=CC(=C(C(=C1C(=O)O)O)[C@@H]2C=C(CC[C@H]2C(=C)C)C)O
Description Cannabidiolic acid (Item No. 18090) is a certified reference material categorized as a phytocannabinoid. Cannabidiolic acid is produced by the oxidocyclization of cannabigerolic acid (Item Nos. 20019 | 9001574) by cannabidiolic acid synthase. This product is intended for research and forensic applications.
Uses Cannabidiolic Acid is a major cannabinoid in fiber-type cannabis, is an inhibitor of MDA-MB-231 breast cancer cell migration. Cannabidiolic Acid offers potential therapeutic value in the abrogation of cancer cell migration and aggressive breast cancers.

Technology Process of Cannabidiolic acid

There total 14 articles about Cannabidiolic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

: C₂₆H₃₈O₄

: 1244-58-2
cannabidiolic acid

Guidance literature:: With trifluoroacetic acid; at 20 - 25 ℃;

Reference yield:

: 763-10-0
geranyl diphosphate

: 1244-58-2
cannabidiolic acid

Guidance literature:: Multi-step reaction with 2 steps

1: aromatic prenyltransferase / Enzymatic reaction

2: cannabidiolic acid synthase / Enzymatic reaction

With aromatic prenyltransferase; cannabidiolic acid synthase;